2-[1,3-bis(oxidanylidene)isoindol-4-yl]sulfanyl-3-chloranyl-propanenitrile

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-4-yl]sulfanyl-3-chloranyl-propanenitrile Openeye Name: 3-chloro-2-(1,3-dioxoisoindolin-4-yl)sulfanyl-propanenitrile CAS Name: 3-chloro-2-[(1,3-dioxo-4-isoindolyl)thio]propanenitrile IUPAC Name: 3-chloro-2-(1,3-dioxoisoindol-4-yl)sulfanylpropanenitrile Traditional Name: 3-chloro-2-[(1,3-diketoisoindolin-4-yl)thio]propionitrile Formula: C11H7ClN2O2S MolecularWeight: 266.70348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SC(CCl)C#N)C(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C(=C1)SC(CCl)C#N)C(=O)NC2=O

InChI

InChI=1S/C11H7ClN2O2S/c12-4-6(5-13)17-8-3-1-2-7-9(8)11(16)14-10(7)15/h1-3,6H,4H2,(H,14,15,16)